3-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methyl-propan-2-yl]amino]-2-(2-methylpropanoyloxy)propoxy]phenyl]propanoic acid hydrochloride

Systemtic Name: 3-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methyl-propan-2-yl]amino]-2-(2-methylpropanoyloxy)propoxy]phenyl]propanoic acid hydrochloride Openeye Name: 3-[4-cyano-3-[(2R)-3-[(2-indan-2-yl-1,1-dimethyl-ethyl)amino]-2-(2-methylpropanoyloxy)propoxy]phenyl]propanoic acid hydrochloride CAS Name: 3-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-(2-methyl-1-oxopropoxy)propoxy]phenyl]propanoic acid hydrochloride IUPAC Name: 3-[4-cyano-3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-(2-methylpropanoyloxy)propoxy]phenyl]propanoic acid hydrochloride Traditional Name: 3-[4-cyano-3-[(2R)-3-[(2-indan-2-yl-1,1-dimethyl-ethyl)amino]-2-isobutyryloxy-propoxy]phenyl]propionic acid hydrochloride Formula: C30H39ClN2O5 MolecularWeight: 543.09406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OC(CNC(C)(C)CC1CC2=CC=CC=C2C1)COC3=C(C=CC(=C3)CCC(=O)O)C#N.Cl

Isomeric SMILES

CC(C)C(=O)O[C@H](CNC(C)(C)CC1CC2=CC=CC=C2C1)COC3=C(C=CC(=C3)CCC(=O)O)C#N.Cl

InChI

InChI=1S/C30H38N2O5.ClH/c1-20(2)29(35)37-26(19-36-27-15-21(10-12-28(33)34)9-11-25(27)17-31)18-32-30(3,4)16-22-13-23-7-5-6-8-24(23)14-22;/h5-9,11,15,20,22,26,32H,10,12-14,16,18-19H2,1-4H3,(H,33,34);1H/t26-;/m1./s1